3617-0028 Screening compound: N-(1,3-benzothiazol-2-yl)propanamide

3617-0028 Screening compound: N-(1,3-benzothiazol-2-yl)propanamide
3617-0028 Screening compound: N-(1,3-benzothiazol-2-yl)propanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 3617-0028
N-(1,3-benzothiazol-2-yl)propanamide

Available from 1 mg

Formats:

  • Glass Vials (4ml Glass Vials VWR #97047-678)
  • 96-tube racks (Matrix #4247 96-well 1.4ml sealed with capmats, empty cols 1 & 12, 100uL of 10mM)

Shiptime: 1 week worldwide delivery in most cases

Compound Identifiers

ChemDiv Compound ID

3617-0028

Molecular Formula

C10H10N2OS (C10 H10 N2 OS)

Compound Name

N-(1,3-benzothiazol-2-yl)propanamide

IUPAC name

N-(13-benzothiazol-2-yl)propanamide

SMILES

CCC(Nc1nc(cccc2)c2s1)=O

InChI

InChI=1S/C10H10N2OS/c1-2-9(13)12-10-11-7-5-3-4-6-8(7)14-10/h3-6H,2H2,1H3,(H,11,12,13)

InChI Key

RYWYJGXIHQNKFE-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00247376

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

206.27

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

2.669

Distribution Coefficient, logD

2.668

Water Solubility, LogSw

-3.06

Polar Surface Area

33.149

Acid Dissociation Constant (pKa)

11.33

Base Dissociation Constant (pKb)

3.56

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

20.00

3617-0028 in Drug Discovery

Included in Screening Libraries

Allosteric Kinases Inhibitors Library (23117 compounds)

Anti-Aging Library (44940 compounds)

Fragments Library (11262 compounds)

Epitranscriptome Focused Small Molecule Library (20952 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Female
  • Congenital
  • Skin
  • Cancer
  • Musculoskeletal
  • Metabolic
  • Immune system
  • Nervous system
  • Hemic and lymphatic
  • Congenital
  • Metabolic
Targets:
  • Kinases
Mechanism of action:
  • Epigenetic
  • Epigenetic
Structure:
  • Fragments

References: we are preparing a list of scientific research reports with 3617-0028 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 3617-0028?
Check Price and Availability of 3617-0028, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of 3617-0028 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 3617-0028
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 3617-0028
  • 0.5–50 mg of dry powder sample in single glass vials, custom vials
  • DMSO solutions frozen 10μl–250μl@10mM (96 and 384 format)

Custom synthesis of 3617-0028 available by request